2-[carboxy-[2-(4-prop-2-enoxyphenyl)ethyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[carboxy-[2-(4-prop-2-enoxyphenyl)ethyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[2-(4-allyloxyphenyl)ethyl-carboxy-amino]-4-methyl-pentanoic acid CAS Name: 2-[carboxy-[2-(4-prop-2-enoxyphenyl)ethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[carboxy-[2-(4-prop-2-enoxyphenyl)ethyl]amino]-4-methylpentanoic acid Traditional Name: 2-[2-(4-allyloxyphenyl)ethyl-carboxy-amino]-4-methyl-valeric acid Formula: C18H25NO5 MolecularWeight: 335.3948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCC1=CC=C(C=C1)OCC=C)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCC1=CC=C(C=C1)OCC=C)C(=O)O

InChI

InChI=1S/C18H25NO5/c1-4-11-24-15-7-5-14(6-8-15)9-10-19(18(22)23)16(17(20)21)12-13(2)3/h4-8,13,16H,1,9-12H2,2-3H3,(H,20,21)(H,22,23)